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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-3-(2,2-dimethylpropyl)-1-methyl-
RN: 132560-04-4
InChIKey: DAEMLJFQJOQHQV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N4-O2

Molecular Weight

  • 236.2734
 
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Names and Synonyms

Synonyms

  • BRN 4192393
  • Xanthine, 3-(2,2-dimethylpropyl)-1-methyl-

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-3-(2,2-dimethylpropyl)-1-methyl-

Registry Numbers

CAS Registry Number

  • 132560-04-4

System Generated Number

  • 0132560044

Structure Descriptors

InChI

1S/C11H16N4O2/c1-11(2,3)5-15-8-7(12-6-13-8)9(16)14(4)10(15)17/h6H,5H2,1-4H3,(H,12,13)

InChIKey

DAEMLJFQJOQHQV-UHFFFAOYSA-N

Smiles

CC(C)(C)Cn1c2c(c(=O)n(c1=O)C)[nH]cn2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 204mg/kg (204mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 25, Pg. 653, 1990.